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5-ALPHA,6,6-TRIFLUORO-ANDROSTAN-3-BETA-OL-17-ONE-ACETATE
SpectraBase Compound ID A3SGke8jAm4
InChI InChI=1S/C21H29F3O3/c1-12(25)27-13-6-9-19(3)16-7-8-18(2)15(4-5-17(18)26)14(16)11-21(23,24)20(19,22)10-13/h13-16H,4-11H2,1-3H3/t13-,14-,15-,16-,18-,19+,20+/m0/s1
InChIKey NMEKLBQMYBYWMO-BSIBEFJDSA-N
Mol Weight 386.46 g/mol
Molecular Formula C21H29F3O3
Exact Mass 386.206879 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jc9XWvw05Z9
Name 5-ALPHA,6,6-TRIFLUORO-ANDROSTAN-3-BETA-OL-17-ONE-ACETATE
Compound Number 11G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H29F3O3
InChI InChI=1S/C21H29F3O3/c1-12(25)27-13-6-9-19(3)16-7-8-18(2)15(4-5-17(18)26)14(16)11-21(23,24)20(19,22)10-13/h13-16H,4-11H2,1-3H3/t13-,14-,15-,16-,18-,19+,20+/m0/s1
InChIKey NMEKLBQMYBYWMO-BSIBEFJDSA-N
Literature Reference Author G.A.BOSWELL
Literature Reference Citation J.ORG.CHEM.,31,991(1966)
Literature Reference DOI 10.1021/jo01342a001
Solvent CDCl3
Source File Reference UWPS2208